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Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate
TL;DR: Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate (CAS 68375-42-8) is a chemical compound with molecular formula C11H12ClN5O4 and molecular weight 313.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate
Also Known As: ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate, ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridin, Ethyl 7-chloro-5-[(ethoxycarbonyl)amino]-3H-[1,2,3]triazolo[4,5-b]pyridine-3-carboxylate
| Molecular Formula | C11H12ClN5O4 |
|---|---|
| Molecular Weight | 313.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.05777 |
| Heavy Atoms | 21 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 68375-42-8 |
|---|---|
| SMILES | CCOC(=O)NC1=NC2=C(C(=C1)Cl)N=NN2C(=O)OCC |
| InChIKey | DXTTXJRQPPKNIK-UHFFFAOYSA-N |
Product Overview
Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate (CAS 68375-42-8), with molecular formula C11H12ClN5O4 and molecular weight 313.06 g/mol. IUPAC: ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate.
Chemical Property Profile of Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate
Property Insights of Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate?
The CAS number of Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate is 68375-42-8.
What is the molecular formula of Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate?
The molecular formula of Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate is C11H12ClN5O4.
What is the molecular weight of Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate?
The molecular weight of Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate is 313.06 g/mol.
Where can I buy Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate?
You can request a quote for Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.